(phenylmethyl) N-[3-[[6-(1-azanylpentan-3-yl)-2-oxidanyl-4-oxidanylidene-pyran-3-yl]-cyclopropyl-methyl]phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[3-[[6-(1-azanylpentan-3-yl)-2-oxidanyl-4-oxidanylidene-pyran-3-yl]-cyclopropyl-methyl]phenyl]carbamate Openeye Name: benzyl N-[3-[[6-(3-amino-1-ethyl-propyl)-2-hydroxy-4-oxo-pyran-3-yl]-cyclopropyl-methyl]phenyl]carbamate CAS Name: N-[3-[[6-(1-aminopentan-3-yl)-2-hydroxy-4-oxo-3-pyranyl]-cyclopropylmethyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[[6-(1-aminopentan-3-yl)-2-hydroxy-4-oxopyran-3-yl]-cyclopropylmethyl]phenyl]carbamate Traditional Name: N-[3-[[6-(3-amino-1-ethyl-propyl)-2-hydroxy-4-keto-pyran-3-yl]-cyclopropyl-methyl]phenyl]carbamic acid benzyl ester Formula: C28H32N2O5 MolecularWeight: 476.56408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCN)C1=CC(=O)C(=C(O1)O)C(C2CC2)C3=CC(=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCC(CCN)C1=CC(=O)C(=C(O1)O)C(C2CC2)C3=CC(=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H32N2O5/c1-2-19(13-14-29)24-16-23(31)26(27(32)35-24)25(20-11-12-20)21-9-6-10-22(15-21)30-28(33)34-17-18-7-4-3-5-8-18/h3-10,15-16,19-20,25,32H,2,11-14,17,29H2,1H3,(H,30,33)