4-chloranylbenzoic acid; 2-(1H-indol-3-yl)ethanamine

Systemtic Name: 4-chloranylbenzoic acid; 2-(1H-indol-3-yl)ethanamine Openeye Name: 4-chlorobenzoic acid; 2-(1H-indol-3-yl)ethanamine CAS Name: 4-chlorobenzoic acid; 2-(1H-indol-3-yl)ethanamine IUPAC Name: 4-chlorobenzoic acid; 2-(1H-indol-3-yl)ethanamine Traditional Name: 4-chlorobenzoic acid; 2-(1H-indol-3-yl)ethylamine Formula: C17H17ClN2O2 MolecularWeight: 316.78208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCN.C1=CC(=CC=C1C(=O)O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCN.C1=CC(=CC=C1C(=O)O)Cl

InChI

InChI=1S/C10H12N2.C7H5ClO2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10;8-6-3-1-5(2-4-6)7(9)10/h1-4,7,12H,5-6,11H2;1-4H,(H,9,10)