3-(7-methoxycarbonyl-2,4-dimethyl-9H-pyrido[2,3-b]indol-3-yl)propanoic acid

Systemtic Name: 3-(7-methoxycarbonyl-2,4-dimethyl-9H-pyrido[2,3-b]indol-3-yl)propanoic acid Openeye Name: 3-(7-methoxycarbonyl-2,4-dimethyl-9H-pyrido[2,3-b]indol-3-yl)propanoic acid CAS Name: 3-(7-methoxycarbonyl-2,4-dimethyl-9H-pyrido[2,3-b]indol-3-yl)propanoic acid IUPAC Name: 3-(7-methoxycarbonyl-2,4-dimethyl-9H-pyrido[2,3-b]indol-3-yl)propanoic acid Traditional Name: 3-(7-carbomethoxy-2,4-dimethyl-9H-pyrid[2,3-b]indol-3-yl)propionic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3=C(C=C(C=C3)C(=O)OC)NC2=NC(=C1CCC(=O)O)C

Isomeric SMILES

CC1=C2C3=C(C=C(C=C3)C(=O)OC)NC2=NC(=C1CCC(=O)O)C

InChI

InChI=1S/C18H18N2O4/c1-9-12(6-7-15(21)22)10(2)19-17-16(9)13-5-4-11(18(23)24-3)8-14(13)20-17/h4-5,8H,6-7H2,1-3H3,(H,19,20)(H,21,22)