propyl 3-(2-azanylpropyl)-6-(7-cyanoindol-1-yl)cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: propyl 3-(2-azanylpropyl)-6-(7-cyanoindol-1-yl)cyclohexa-1,3-diene-1-carboxylate Openeye Name: propyl 3-(2-aminopropyl)-6-(7-cyanoindol-1-yl)cyclohexa-1,3-diene-1-carboxylate CAS Name: 3-(2-aminopropyl)-6-(7-cyano-1-indolyl)-1-cyclohexa-1,3-dienecarboxylic acid propyl ester IUPAC Name: propyl 3-(2-aminopropyl)-6-(7-cyanoindol-1-yl)cyclohexa-1,3-diene-1-carboxylate Traditional Name: 3-(2-aminopropyl)-6-(7-cyanoindol-1-yl)cyclohexa-1,3-diene-1-carboxylic acid propyl ester Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CCC1N2C=CC3=CC=CC(=C32)C#N)CC(C)N

Isomeric SMILES

CCCOC(=O)C1=CC(=CCC1N2C=CC3=CC=CC(=C32)C#N)CC(C)N

InChI

InChI=1S/C22H25N3O2/c1-3-11-27-22(26)19-13-16(12-15(2)24)7-8-20(19)25-10-9-17-5-4-6-18(14-23)21(17)25/h4-7,9-10,13,15,20H,3,8,11-12,24H2,1-2H3