2-[3-[[(3-methoxyphenyl)-propan-2-yl-carbamoyl]-propan-2-yl-amino]-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[[(3-methoxyphenyl)-propan-2-yl-carbamoyl]-propan-2-yl-amino]-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[3-[isopropyl-[isopropyl-(3-methoxyphenyl)carbamoyl]amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[3-[[(3-methoxy-N-propan-2-ylanilino)-oxomethyl]-propan-2-ylamino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[3-[[(3-methoxyphenyl)-propan-2-ylcarbamoyl]-propan-2-ylamino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[3-[isopropyl-[isopropyl-(3-methoxyphenyl)carbamoyl]amino]-2-keto-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C32H37N3O5 MolecularWeight: 543.65328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1CC(C2=CC=CC=C2N(C1=O)CC(=O)O)C3=CC=CC=C3)C(=O)N(C4=CC(=CC=C4)OC)C(C)C

Isomeric SMILES

CC(C)N(C1CC(C2=CC=CC=C2N(C1=O)CC(=O)O)C3=CC=CC=C3)C(=O)N(C4=CC(=CC=C4)OC)C(C)C

InChI

InChI=1S/C32H37N3O5/c1-21(2)34(24-14-11-15-25(18-24)40-5)32(39)35(22(3)4)29-19-27(23-12-7-6-8-13-23)26-16-9-10-17-28(26)33(31(29)38)20-30(36)37/h6-18,21-22,27,29H,19-20H2,1-5H3,(H,36,37)