3-(4-hydroxyphenyl)-2-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]propanoic acid Openeye Name: 3-(4-hydroxyphenyl)-2-[(1-methyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-[(1-methyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]propanoic acid Traditional Name: 3-(4-hydroxyphenyl)-2-[(1-methyl-9H-$b-carboline-3-carbonyl)amino]propionic acid Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=N1)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)O)C4=CC=CC=C4N2

Isomeric SMILES

CC1=C2C(=CC(=N1)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)O)C4=CC=CC=C4N2

InChI

InChI=1S/C22H19N3O4/c1-12-20-16(15-4-2-3-5-17(15)24-20)11-18(23-12)21(27)25-19(22(28)29)10-13-6-8-14(26)9-7-13/h2-9,11,19,24,26H,10H2,1H3,(H,25,27)(H,28,29)