1-[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C19H15ClN2O5 MolecularWeight: 386.7858

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2N(C1)C(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2N(C1)C(=O)/C=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C19H15ClN2O5/c20-15-8-6-12(11-17(15)22(26)27)7-9-18(23)21-10-2-4-13-14(19(24)25)3-1-5-16(13)21/h1,3,5-9,11H,2,4,10H2,(H,24,25)/b9-7+