6-[[(3R,4R,5S)-4-[4-[[(2R)-2-ethoxypropoxy]methyl]phenyl]-5-(pyrrolidin-1-ylmethyl)piperidin-3-yl]oxymethyl]-4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 6-[[(3R,4R,5S)-4-[4-[[(2R)-2-ethoxypropoxy]methyl]phenyl]-5-(pyrrolidin-1-ylmethyl)piperidin-3-yl]oxymethyl]-4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazine Openeye Name: 6-[[(3R,4R,5S)-4-[4-[[(2R)-2-ethoxypropoxy]methyl]phenyl]-5-(pyrrolidin-1-ylmethyl)-3-piperidyl]oxymethyl]-4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazine CAS Name: 6-[[(3R,4R,5S)-4-[4-[[(2R)-2-ethoxypropoxy]methyl]phenyl]-5-(1-pyrrolidinylmethyl)-3-piperidinyl]oxymethyl]-4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazine IUPAC Name: 6-[[(3R,4R,5S)-4-[4-[[(2R)-2-ethoxypropoxy]methyl]phenyl]-5-(pyrrolidin-1-ylmethyl)piperidin-3-yl]oxymethyl]-4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazine Traditional Name: 6-[[(3R,4R,5S)-4-[4-[[(2R)-2-ethoxypropoxy]methyl]phenyl]-5-(pyrrolidinomethyl)-3-piperidyl]oxymethyl]-4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazine Formula: C35H53N3O5 MolecularWeight: 595.81242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)COCC1=CC=C(C=C1)C2C(CNCC2OCC3=CC4=C(C=C3)OCCN4CCCOC)CN5CCCC5

Isomeric SMILES

CCO[C@H](C)COCC1=CC=C(C=C1)[C@H]2[C@@H](CNC[C@@H]2OCC3=CC4=C(C=C3)OCCN4CCCOC)CN5CCCC5

InChI

InChI=1S/C35H53N3O5/c1-4-41-27(2)24-40-25-28-8-11-30(12-9-28)35-31(23-37-14-5-6-15-37)21-36-22-34(35)43-26-29-10-13-33-32(20-29)38(17-19-42-33)16-7-18-39-3/h8-13,20,27,31,34-36H,4-7,14-19,21-26H2,1-3H3/t27-,31+,34+,35+/m1/s1