2-ethoxy-3-[4-[3-[7-oxidanylidene-4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]phenyl]propanamide

Systemtic Name: 2-ethoxy-3-[4-[3-[7-oxidanylidene-4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]phenyl]propanamide Openeye Name: 3-[4-[3-(4-benzyl-7-oxo-1,4-diazepan-1-yl)propyl]phenyl]-2-ethoxy-propanamide CAS Name: 2-ethoxy-3-[4-[3-[7-oxo-4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]phenyl]propanamide IUPAC Name: 3-[4-[3-(4-benzyl-7-oxo-1,4-diazepan-1-yl)propyl]phenyl]-2-ethoxypropanamide Traditional Name: 3-[4-[3-(4-benzyl-7-keto-1,4-diazepan-1-yl)propyl]phenyl]-2-ethoxy-propionamide Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)CCCN2CCN(CCC2=O)CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)CCCN2CCN(CCC2=O)CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C26H35N3O3/c1-2-32-24(26(27)31)19-22-12-10-21(11-13-22)9-6-15-29-18-17-28(16-14-25(29)30)20-23-7-4-3-5-8-23/h3-5,7-8,10-13,24H,2,6,9,14-20H2,1H3,(H2,27,31)