2-[[2-[(1,5-dimethylindol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[(1,5-dimethylindol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[[(1,5-dimethyl-2-indolyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-methylbutanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butyric acid Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(C(C)C)C(=O)NC(C(C)C)C(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(C(C)C)C(=O)NC(C(C)C)C(=O)O)C

InChI

InChI=1S/C21H29N3O4/c1-11(2)17(20(26)23-18(12(3)4)21(27)28)22-19(25)16-10-14-9-13(5)7-8-15(14)24(16)6/h7-12,17-18H,1-6H3,(H,22,25)(H,23,26)(H,27,28)