tert-butyl 2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3-[2-[(4-methylphenyl)sulfonylamino]ethyl]indole-1-carboxylate

Systemtic Name: tert-butyl 2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3-[2-[(4-methylphenyl)sulfonylamino]ethyl]indole-1-carboxylate Openeye Name: tert-butyl 2-[(E)-3-ethoxy-3-oxo-prop-1-enyl]-3-[2-(p-tolylsulfonylamino)ethyl]indole-1-carboxylate CAS Name: 2-[(E)-3-ethoxy-3-oxoprop-1-enyl]-3-[2-[(4-methylphenyl)sulfonylamino]ethyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(E)-3-ethoxy-3-oxoprop-1-enyl]-3-[2-[(4-methylphenyl)sulfonylamino]ethyl]indole-1-carboxylate Traditional Name: 2-[(E)-3-ethoxy-3-keto-prop-1-enyl]-3-[2-(tosylamino)ethyl]indole-1-carboxylic acid tert-butyl ester Formula: C27H32N2O6S MolecularWeight: 512.61778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C2=CC=CC=C2N1C(=O)OC(C)(C)C)CCNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C2=CC=CC=C2N1C(=O)OC(C)(C)C)CCNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C27H32N2O6S/c1-6-34-25(30)16-15-24-22(17-18-28-36(32,33)20-13-11-19(2)12-14-20)21-9-7-8-10-23(21)29(24)26(31)35-27(3,4)5/h7-16,28H,6,17-18H2,1-5H3/b16-15+