3-[5-chloranyl-2-(4-methylphenyl)-1H-indol-3-yl]propanoate

Systemtic Name: 3-[5-chloranyl-2-(4-methylphenyl)-1H-indol-3-yl]propanoate Openeye Name: 3-[5-chloro-2-(p-tolyl)-1H-indol-3-yl]propanoate CAS Name: 3-[5-chloro-2-(4-methylphenyl)-1H-indol-3-yl]propanoate IUPAC Name: 3-[5-chloro-2-(4-methylphenyl)-1H-indol-3-yl]propanoate Traditional Name: 3-[5-chloro-2-(p-tolyl)-1H-indol-3-yl]propionate Formula: C18H15ClNO2- MolecularWeight: 312.7702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)Cl)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)Cl)CCC(=O)[O-]

InChI

InChI=1S/C18H16ClNO2/c1-11-2-4-12(5-3-11)18-14(7-9-17(21)22)15-10-13(19)6-8-16(15)20-18/h2-6,8,10,20H,7,9H2,1H3,(H,21,22)/p-1