2-[(2-azanyl-3-methyl-butanoyl)-(2,3-dihydro-1H-inden-2-yl)amino]-3-(4-methoxycarbonylphenyl)-3-oxidanylidene-propanoic acid

Systemtic Name: 2-[(2-azanyl-3-methyl-butanoyl)-(2,3-dihydro-1H-inden-2-yl)amino]-3-(4-methoxycarbonylphenyl)-3-oxidanylidene-propanoic acid Openeye Name: 2-[(2-amino-3-methyl-butanoyl)-indan-2-yl-amino]-3-(4-methoxycarbonylphenyl)-3-oxo-propanoic acid CAS Name: 2-[(2-amino-3-methyl-1-oxobutyl)-(2,3-dihydro-1H-inden-2-yl)amino]-3-(4-methoxycarbonylphenyl)-3-oxopropanoic acid IUPAC Name: 2-[(2-amino-3-methylbutanoyl)-(2,3-dihydro-1H-inden-2-yl)amino]-3-(4-methoxycarbonylphenyl)-3-oxopropanoic acid Traditional Name: 2-[(2-amino-3-methyl-butanoyl)-indan-2-yl-amino]-3-(4-carbomethoxyphenyl)-3-keto-propionic acid Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C1CC2=CC=CC=C2C1)C(C(=O)C3=CC=C(C=C3)C(=O)OC)C(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)N(C1CC2=CC=CC=C2C1)C(C(=O)C3=CC=C(C=C3)C(=O)OC)C(=O)O)N

InChI

InChI=1S/C25H28N2O6/c1-14(2)20(26)23(29)27(19-12-17-6-4-5-7-18(17)13-19)21(24(30)31)22(28)15-8-10-16(11-9-15)25(32)33-3/h4-11,14,19-21H,12-13,26H2,1-3H3,(H,30,31)