4-[3-(2-methylpropoxy)-2-piperidin-1-yl-propyl]-3-(4-propoxyphenyl)-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 4-[3-(2-methylpropoxy)-2-piperidin-1-yl-propyl]-3-(4-propoxyphenyl)-2,3-dihydro-1,4-benzoxazine Openeye Name: 4-[3-isobutoxy-2-(1-piperidyl)propyl]-3-(4-propoxyphenyl)-2,3-dihydro-1,4-benzoxazine CAS Name: 4-[3-(2-methylpropoxy)-2-(1-piperidinyl)propyl]-3-(4-propoxyphenyl)-2,3-dihydro-1,4-benzoxazine IUPAC Name: 4-[3-(2-methylpropoxy)-2-piperidin-1-ylpropyl]-3-(4-propoxyphenyl)-2,3-dihydro-1,4-benzoxazine Traditional Name: 4-(3-isobutoxy-2-piperidino-propyl)-3-(4-propoxyphenyl)-2,3-dihydro-1,4-benzoxazine Formula: C29H42N2O3 MolecularWeight: 466.65538

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2COC3=CC=CC=C3N2CC(COCC(C)C)N4CCCCC4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2COC3=CC=CC=C3N2CC(COCC(C)C)N4CCCCC4

InChI

InChI=1S/C29H42N2O3/c1-4-18-33-26-14-12-24(13-15-26)28-22-34-29-11-7-6-10-27(29)31(28)19-25(21-32-20-23(2)3)30-16-8-5-9-17-30/h6-7,10-15,23,25,28H,4-5,8-9,16-22H2,1-3H3