9-ethanoyl-5-(imidazol-1-ylmethyl)pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 9-ethanoyl-5-(imidazol-1-ylmethyl)pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 9-acetyl-5-(imidazol-1-ylmethyl)pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 9-acetyl-5-(1-imidazolylmethyl)-3-pyrido[3,4-b]indolecarboxylic acid IUPAC Name: 9-acetyl-5-(imidazol-1-ylmethyl)pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 9-acetyl-5-(imidazol-1-ylmethyl)-$b-carboline-3-carboxylic acid Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC=CC(=C2C3=CC(=NC=C31)C(=O)O)CN4C=CN=C4

Isomeric SMILES

CC(=O)N1C2=CC=CC(=C2C3=CC(=NC=C31)C(=O)O)CN4C=CN=C4

InChI

InChI=1S/C18H14N4O3/c1-11(23)22-15-4-2-3-12(9-21-6-5-19-10-21)17(15)13-7-14(18(24)25)20-8-16(13)22/h2-8,10H,9H2,1H3,(H,24,25)