methyl 5-(3-cyanopropyl)-6-oxidanylidene-phenanthridine-2-carboxylate

Systemtic Name: methyl 5-(3-cyanopropyl)-6-oxidanylidene-phenanthridine-2-carboxylate Openeye Name: methyl 5-(3-cyanopropyl)-6-oxo-phenanthridine-2-carboxylate CAS Name: 5-(3-cyanopropyl)-6-oxo-2-phenanthridinecarboxylic acid methyl ester IUPAC Name: methyl 5-(3-cyanopropyl)-6-oxophenanthridine-2-carboxylate Traditional Name: 5-(3-cyanopropyl)-6-keto-phenanthridine-2-carboxylic acid methyl ester Formula: C19H16N2O3 MolecularWeight: 320.34194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C(=O)C3=CC=CC=C32)CCCC#N

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C(=O)C3=CC=CC=C32)CCCC#N

InChI

InChI=1S/C19H16N2O3/c1-24-19(23)13-8-9-17-16(12-13)14-6-2-3-7-15(14)18(22)21(17)11-5-4-10-20/h2-3,6-9,12H,4-5,11H2,1H3