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

Systemtic Name: [(5R)-11-aminocarbonyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl] 4-chloranylbenzoate Openeye Name: [(5R)-11-carbamoyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(5R)-11-carbamoyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl] ester IUPAC Name: [(5R)-11-carbamoyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(5R)-11-carbamoyl-5,6-dihydrobenzo[b][1]benzazepin-5-yl] ester Formula: C22H17ClN2O3 MolecularWeight: 392.83498

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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=C(C=C4)Cl

Isomeric SMILES

C1[C@H](C2=CC=CC=C2N(C3=CC=CC=C31)C(=O)N)OC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN2O3/c23-16-11-9-14(10-12-16)21(26)28-20-13-15-5-1-3-7-18(15)25(22(24)27)19-8-4-2-6-17(19)20/h1-12,20H,13H2,(H2,24,27)/t20-/m1/s1