3-[[(2S)-2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]propanoic acid

Systemtic Name: 3-[[(2S)-2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]propanoic acid Openeye Name: 3-[[(2S)-2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]-3-methyl-butanoyl]amino]propanoic acid CAS Name: 3-[[(2S)-2-[[(5-methoxy-1-methyl-2-indolyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]propanoic acid IUPAC Name: 3-[[(2S)-2-[(5-methoxy-1-methylindole-2-carbonyl)amino]-3-methylbutanoyl]amino]propanoic acid Traditional Name: 3-[[(2S)-2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]-3-methyl-butanoyl]amino]propionic acid Formula: C19H25N3O5 MolecularWeight: 375.4189

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCC(=O)O)NC(=O)C1=CC2=C(N1C)C=CC(=C2)OC

InChI

InChI=1S/C19H25N3O5/c1-11(2)17(19(26)20-8-7-16(23)24)21-18(25)15-10-12-9-13(27-4)5-6-14(12)22(15)3/h5-6,9-11,17H,7-8H2,1-4H3,(H,20,26)(H,21,25)(H,23,24)/t17-/m0/s1