(E)-3-(4-chloranyl-3-nitro-phenyl)-N-(1,2-dihydroacenaphthylen-5-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-N-(1,2-dihydroacenaphthylen-5-yl)prop-2-enamide Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-(1,2-dihydroacenaphthylen-5-yl)prop-2-enamide CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-N-(1,2-dihydroacenaphthylen-5-yl)-2-propenamide IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-N-(1,2-dihydroacenaphthylen-5-yl)prop-2-enamide Traditional Name: (E)-N-acenaphthen-5-yl-3-(4-chloro-3-nitro-phenyl)acrylamide Formula: C21H15ClN2O3 MolecularWeight: 378.8084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)/C=C/C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H15ClN2O3/c22-17-9-4-13(12-19(17)24(26)27)5-11-20(25)23-18-10-8-15-7-6-14-2-1-3-16(18)21(14)15/h1-5,8-12H,6-7H2,(H,23,25)/b11-5+