2-[2-(3-phenylpropanoyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]ethanoic acid

Systemtic Name: 2-[2-(3-phenylpropanoyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]ethanoic acid Openeye Name: 2-[2-(3-phenylpropanoyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]acetic acid CAS Name: 2-[2-(1-oxo-3-phenylpropyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]acetic acid IUPAC Name: 2-[2-(3-phenylpropanoyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]acetic acid Traditional Name: 2-(2-hydrocinnamoyl-3,4-dihydro-1H-pyrid[4,3-b]indol-5-yl)acetic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1N(C3=CC=CC=C23)CC(=O)O)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1N(C3=CC=CC=C23)CC(=O)O)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C22H22N2O3/c25-21(11-10-16-6-2-1-3-7-16)23-13-12-20-18(14-23)17-8-4-5-9-19(17)24(20)15-22(26)27/h1-9H,10-15H2,(H,26,27)