3-(3-azanylpropyl)-5-[(3-methoxyphenyl)carbamoyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-(3-azanylpropyl)-5-[(3-methoxyphenyl)carbamoyl]-1H-indole-2-carboxylic acid Openeye Name: 3-(3-aminopropyl)-5-[(3-methoxyphenyl)carbamoyl]-1H-indole-2-carboxylic acid CAS Name: 3-(3-aminopropyl)-5-[(3-methoxyanilino)-oxomethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-(3-aminopropyl)-5-[(3-methoxyphenyl)carbamoyl]-1H-indole-2-carboxylic acid Traditional Name: 3-(3-aminopropyl)-5-[(3-methoxyphenyl)carbamoyl]-1H-indole-2-carboxylic acid Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2=CC3=C(C=C2)NC(=C3CCCN)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2=CC3=C(C=C2)NC(=C3CCCN)C(=O)O

InChI

InChI=1S/C20H21N3O4/c1-27-14-5-2-4-13(11-14)22-19(24)12-7-8-17-16(10-12)15(6-3-9-21)18(23-17)20(25)26/h2,4-5,7-8,10-11,23H,3,6,9,21H2,1H3,(H,22,24)(H,25,26)