1-acetamidoethyl-[2-[[(2S)-3-(4-methoxycarbonylphenyl)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]carbamoyl]cyclopentyl]phosphinic acid

Systemtic Name: 1-acetamidoethyl-[2-[[(2S)-3-(4-methoxycarbonylphenyl)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]carbamoyl]cyclopentyl]phosphinic acid Openeye Name: 1-acetamidoethyl-[2-[[(1S)-2-anilino-1-[(4-methoxycarbonylphenyl)methyl]-2-oxo-ethyl]carbamoyl]cyclopentyl]phosphinic acid CAS Name: 1-acetamidoethyl-[2-[[[(2S)-1-anilino-3-(4-methoxycarbonylphenyl)-1-oxopropan-2-yl]amino]-oxomethyl]cyclopentyl]phosphinic acid IUPAC Name: 1-acetamidoethyl-[2-[[(2S)-1-anilino-3-(4-methoxycarbonylphenyl)-1-oxopropan-2-yl]carbamoyl]cyclopentyl]phosphinic acid Traditional Name: 1-acetamidoethyl-[2-[[(1S)-2-anilino-1-(4-carbomethoxybenzyl)-2-keto-ethyl]carbamoyl]cyclopentyl]phosphinic acid Formula: C27H34N3O7P MolecularWeight: 543.548521

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)C)P(=O)(C1CCCC1C(=O)NC(CC2=CC=C(C=C2)C(=O)OC)C(=O)NC3=CC=CC=C3)O

Isomeric SMILES

CC(NC(=O)C)P(=O)(C1CCCC1C(=O)N[C@@H](CC2=CC=C(C=C2)C(=O)OC)C(=O)NC3=CC=CC=C3)O

InChI

InChI=1S/C27H34N3O7P/c1-17(31)28-18(2)38(35,36)24-11-7-10-22(24)25(32)30-23(26(33)29-21-8-5-4-6-9-21)16-19-12-14-20(15-13-19)27(34)37-3/h4-6,8-9,12-15,18,22-24H,7,10-11,16H2,1-3H3,(H,28,31)(H,29,33)(H,30,32)(H,35,36)/t18?,22?,23-,24?/m0/s1