3-(4-azanylbutyl)-7-chloranyl-2-(1-methoxynaphthalen-2-yl)-1H-indole-4-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-7-chloranyl-2-(1-methoxynaphthalen-2-yl)-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-7-chloro-2-(1-methoxy-2-naphthyl)-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-7-chloro-2-(1-methoxy-2-naphthalenyl)-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-7-chloro-2-(1-methoxynaphthalen-2-yl)-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-7-chloro-2-(1-methoxy-2-naphthyl)-1H-indole-4-carboxylic acid Formula: C24H23ClN2O3 MolecularWeight: 422.90402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=CC=CC=C21)C3=C(C4=C(C=CC(=C4N3)Cl)C(=O)O)CCCCN

Isomeric SMILES

COC1=C(C=CC2=CC=CC=C21)C3=C(C4=C(C=CC(=C4N3)Cl)C(=O)O)CCCCN

InChI

InChI=1S/C24H23ClN2O3/c1-30-23-15-7-3-2-6-14(15)9-10-18(23)21-16(8-4-5-13-26)20-17(24(28)29)11-12-19(25)22(20)27-21/h2-3,6-7,9-12,27H,4-5,8,13,26H2,1H3,(H,28,29)