(E)-N-[2-(azepan-1-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(azepan-1-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-(azepan-1-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-(1-azepanyl)phenyl]-3-(2-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(azepan-1-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[2-(azepan-1-yl)phenyl]-3-(2-nitrophenyl)acrylamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C=CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)/C=C/C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O3/c25-21(14-13-17-9-3-5-11-19(17)24(26)27)22-18-10-4-6-12-20(18)23-15-7-1-2-8-16-23/h3-6,9-14H,1-2,7-8,15-16H2,(H,22,25)/b14-13+