2-[[5-azanyl-4-methyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)-(4-phenylphenyl)amino]pentan-2-yl]amino]hexanoic acid

Systemtic Name: 2-[[5-azanyl-4-methyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)-(4-phenylphenyl)amino]pentan-2-yl]amino]hexanoic acid Openeye Name: 2-[[4-amino-1-[(2-hydroxy-1-methyl-2-oxo-ethyl)-(4-phenylphenyl)carbamoyl]-3-methyl-butyl]amino]hexanoic acid CAS Name: 2-[[5-amino-1-(N-(1-hydroxy-1-oxopropan-2-yl)-4-phenylanilino)-4-methyl-1-oxopentan-2-yl]amino]hexanoic acid IUPAC Name: 2-[[5-amino-1-(N-(1-hydroxy-1-oxopropan-2-yl)-4-phenylanilino)-4-methyl-1-oxopentan-2-yl]amino]hexanoic acid Traditional Name: 2-[[4-amino-1-[(2-hydroxy-2-keto-1-methyl-ethyl)-(4-phenylphenyl)carbamoyl]-3-methyl-butyl]amino]hexanoic acid Formula: C27H37N3O5 MolecularWeight: 483.59978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(CC(C)CN)C(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2)C(C)C(=O)O

Isomeric SMILES

CCCCC(C(=O)O)NC(CC(C)CN)C(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2)C(C)C(=O)O

InChI

InChI=1S/C27H37N3O5/c1-4-5-11-23(27(34)35)29-24(16-18(2)17-28)25(31)30(19(3)26(32)33)22-14-12-21(13-15-22)20-9-7-6-8-10-20/h6-10,12-15,18-19,23-24,29H,4-5,11,16-17,28H2,1-3H3,(H,32,33)(H,34,35)