4-(naphthalen-2-ylmethyl)-1-[(E)-3-pyridin-2-ylprop-2-enoyl]-1,4-diazepan-5-one

Systemtic Name: 4-(naphthalen-2-ylmethyl)-1-[(E)-3-pyridin-2-ylprop-2-enoyl]-1,4-diazepan-5-one Openeye Name: 4-(2-naphthylmethyl)-1-[(E)-3-(2-pyridyl)prop-2-enoyl]-1,4-diazepan-5-one CAS Name: 4-(2-naphthalenylmethyl)-1-[(E)-1-oxo-3-(2-pyridinyl)prop-2-enyl]-1,4-diazepan-5-one IUPAC Name: 4-(naphthalen-2-ylmethyl)-1-[(E)-3-pyridin-2-ylprop-2-enoyl]-1,4-diazepan-5-one Traditional Name: 4-(2-naphthylmethyl)-1-[(E)-3-(2-pyridyl)acryloyl]-1,4-diazepan-5-one Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CC2=CC3=CC=CC=C3C=C2)C(=O)C=CC4=CC=CC=N4

Isomeric SMILES

C1CN(CCN(C1=O)CC2=CC3=CC=CC=C3C=C2)C(=O)/C=C/C4=CC=CC=N4

InChI

InChI=1S/C24H23N3O2/c28-23(11-10-22-7-3-4-13-25-22)26-14-12-24(29)27(16-15-26)18-19-8-9-20-5-1-2-6-21(20)17-19/h1-11,13,17H,12,14-16,18H2/b11-10+