(3S)-3-(5-chloranyl-1H-indol-3-yl)-3-(4-methylphenyl)propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)[O-])C2=CNC3=C2C=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CC(=O)[O-])C2=CNC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C18H16ClNO2/c1-11-2-4-12(5-3-11)14(9-18(21)22)16-10-20-17-7-6-13(19)8-15(16)17/h2-8,10,14,20H,9H2,1H3,(H,21,22)/p-1/t14-/m0/s1