methyl 2-[(1-methylsulfonylspiro[2H-indole-3,4'-cyclohexane]-1'-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(1-methylsulfonylspiro[2H-indole-3,4'-cyclohexane]-1'-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(1'-methylsulfonylspiro[cyclohexane-4,3'-indoline]-1-carbonyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(1-methylsulfonyl-1'-spiro[2H-indole-3,4'-cyclohexane]yl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(1-methylsulfonylspiro[2H-indole-3,4'-cyclohexane]-1'-carbonyl)amino]-3-phenylpropanoate Traditional Name: 2-[(1'-mesylspiro[cyclohexane-4,3'-indoline]-1-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCC3(CC2)CN(C4=CC=CC=C34)S(=O)(=O)C

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCC3(CC2)CN(C4=CC=CC=C34)S(=O)(=O)C

InChI

InChI=1S/C25H30N2O5S/c1-32-24(29)21(16-18-8-4-3-5-9-18)26-23(28)19-12-14-25(15-13-19)17-27(33(2,30)31)22-11-7-6-10-20(22)25/h3-11,19,21H,12-17H2,1-2H3,(H,26,28)