2-[5-cyano-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethylcarbamic acid

Systemtic Name: 2-[5-cyano-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethylcarbamic acid Openeye Name: 2-[5-cyano-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethylcarbamic acid CAS Name: 2-[5-cyano-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethylcarbamic acid IUPAC Name: 2-[5-cyano-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethylcarbamic acid Traditional Name: 2-[5-cyano-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethylcarbamic acid Formula: C20H19N3O2 MolecularWeight: 333.38376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C#N)CCNC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C#N)CCNC(=O)O)C

InChI

InChI=1S/C20H19N3O2/c1-12-7-13(2)9-15(8-12)19-16(5-6-22-20(24)25)17-10-14(11-21)3-4-18(17)23-19/h3-4,7-10,22-23H,5-6H2,1-2H3,(H,24,25)