N-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]furan-2-carboxamide

Systemtic Name: N-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]furan-2-carboxamide Openeye Name: N-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxo-propyl]furan-2-carboxamide CAS Name: N-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-2-furancarboxamide IUPAC Name: N-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]furan-2-carboxamide Traditional Name: N-[3-keto-3-(4-p-anisyl-1,4-diazepan-1-yl)propyl]-2-furamide Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CCNC(=O)C3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CCNC(=O)C3=CC=CO3

InChI

InChI=1S/C21H27N3O4/c1-27-18-7-5-17(6-8-18)16-23-11-3-12-24(14-13-23)20(25)9-10-22-21(26)19-4-2-15-28-19/h2,4-8,15H,3,9-14,16H2,1H3,(H,22,26)