pentyl 1-[7-acetamido-5,8-bis(oxidanylidene)quinolin-2-yl]-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: pentyl 1-[7-acetamido-5,8-bis(oxidanylidene)quinolin-2-yl]-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: pentyl 1-(7-acetamido-5,8-dioxo-2-quinolyl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(7-acetamido-5,8-dioxo-2-quinolinyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid pentyl ester IUPAC Name: pentyl 1-(7-acetamido-5,8-dioxoquinolin-2-yl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(7-acetamido-5,8-diketo-2-quinolyl)-9H-$b-carboline-3-carboxylic acid amyl ester Formula: C28H24N4O5 MolecularWeight: 496.51396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4=NC5=C(C=C4)C(=O)C=C(C5=O)NC(=O)C

Isomeric SMILES

CCCCCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4=NC5=C(C=C4)C(=O)C=C(C5=O)NC(=O)C

InChI

InChI=1S/C28H24N4O5/c1-3-4-7-12-37-28(36)22-13-18-16-8-5-6-9-19(16)30-24(18)26(32-22)20-11-10-17-23(34)14-21(29-15(2)33)27(35)25(17)31-20/h5-6,8-11,13-14,30H,3-4,7,12H2,1-2H3,(H,29,33)