[2-[(1-cyanocycloheptyl)amino]-2-oxidanylidene-ethyl] 2-methyl-1H-indole-3-carboxylate

Systemtic Name: [2-[(1-cyanocycloheptyl)amino]-2-oxidanylidene-ethyl] 2-methyl-1H-indole-3-carboxylate Openeye Name: [2-[(1-cyanocycloheptyl)amino]-2-oxo-ethyl] 2-methyl-1H-indole-3-carboxylate CAS Name: 2-methyl-1H-indole-3-carboxylic acid [2-[(1-cyanocycloheptyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocycloheptyl)amino]-2-oxoethyl] 2-methyl-1H-indole-3-carboxylate Traditional Name: 2-methyl-1H-indole-3-carboxylic acid [2-[(1-cyanocycloheptyl)amino]-2-keto-ethyl] ester Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)OCC(=O)NC3(CCCCCC3)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)OCC(=O)NC3(CCCCCC3)C#N

InChI

InChI=1S/C20H23N3O3/c1-14-18(15-8-4-5-9-16(15)22-14)19(25)26-12-17(24)23-20(13-21)10-6-2-3-7-11-20/h4-5,8-9,22H,2-3,6-7,10-12H2,1H3,(H,23,24)