ethyl 1-[3-(cycloheptylamino)-3-oxidanylidene-propyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[3-(cycloheptylamino)-3-oxidanylidene-propyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-(cycloheptylamino)-3-oxo-propyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylate CAS Name: 1-[3-(cycloheptylamino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(cycloheptylamino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 1-[3-(cycloheptylamino)-3-keto-propyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylic acid ethyl ester Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CCC(=O)NC3CCCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CCC(=O)NC3CCCCCC3)C

InChI

InChI=1S/C25H34N2O3/c1-4-30-25(29)22-17-23(20-13-11-18(2)12-14-20)27(19(22)3)16-15-24(28)26-21-9-7-5-6-8-10-21/h11-14,17,21H,4-10,15-16H2,1-3H3,(H,26,28)