2-[2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]propanoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]propanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]propanoylamino]-3-methyl-pentanoic acid CAS Name: 2-[[2-[[(5-methoxy-1-methyl-2-indolyl)-oxomethyl]amino]-1-oxopropyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[2-[(5-methoxy-1-methylindole-2-carbonyl)amino]propanoylamino]-3-methylpentanoic acid Traditional Name: 2-[2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]propanoylamino]-3-methyl-valeric acid Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C1=CC2=C(N1C)C=CC(=C2)OC

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C1=CC2=C(N1C)C=CC(=C2)OC

InChI

InChI=1S/C20H27N3O5/c1-6-11(2)17(20(26)27)22-18(24)12(3)21-19(25)16-10-13-9-14(28-5)7-8-15(13)23(16)4/h7-12,17H,6H2,1-5H3,(H,21,25)(H,22,24)(H,26,27)