(11-aminocarbonyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl) pyridine-4-carboxylate

Systemtic Name: (11-aminocarbonyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl) pyridine-4-carboxylate Openeye Name: (11-carbamoyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl) pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid (11-carbamoyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl) ester IUPAC Name: (11-carbamoyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl) pyridine-4-carboxylate Traditional Name: isonicotinic acid (11-carbamoyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl) ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2N(C3=CC=CC=C31)C(=O)N)OC(=O)C4=CC=NC=C4

Isomeric SMILES

C1C(C2=CC=CC=C2N(C3=CC=CC=C31)C(=O)N)OC(=O)C4=CC=NC=C4

InChI

InChI=1S/C21H17N3O3/c22-21(26)24-17-7-3-1-5-15(17)13-19(16-6-2-4-8-18(16)24)27-20(25)14-9-11-23-12-10-14/h1-12,19H,13H2,(H2,22,26)