tert-butyl 7-[(5-cyano-1H-indol-2-yl)carbonylamino]-3-ethyl-heptanoate

Systemtic Name: tert-butyl 7-[(5-cyano-1H-indol-2-yl)carbonylamino]-3-ethyl-heptanoate Openeye Name: tert-butyl 7-[(5-cyano-1H-indole-2-carbonyl)amino]-3-ethyl-heptanoate CAS Name: 7-[[(5-cyano-1H-indol-2-yl)-oxomethyl]amino]-3-ethylheptanoic acid tert-butyl ester IUPAC Name: tert-butyl 7-[(5-cyano-1H-indole-2-carbonyl)amino]-3-ethylheptanoate Traditional Name: 7-[(5-cyano-1H-indole-2-carbonyl)amino]-3-ethyl-enanthic acid tert-butyl ester Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C#N)CC(=O)OC(C)(C)C

Isomeric SMILES

CCC(CCCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C#N)CC(=O)OC(C)(C)C

InChI

InChI=1S/C23H31N3O3/c1-5-16(13-21(27)29-23(2,3)4)8-6-7-11-25-22(28)20-14-18-12-17(15-24)9-10-19(18)26-20/h9-10,12,14,16,26H,5-8,11,13H2,1-4H3,(H,25,28)