ethyl 5-[3-[(4-dimethylaminophenyl)methylamino]-3-oxidanylidene-propyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[3-[(4-dimethylaminophenyl)methylamino]-3-oxidanylidene-propyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[3-[(4-dimethylaminophenyl)methylamino]-3-oxo-propyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[3-[(4-dimethylaminophenyl)methylamino]-3-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-[(4-dimethylaminophenyl)methylamino]-3-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[3-[[4-(dimethylamino)benzyl]amino]-3-keto-propyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)CCC(=O)NCC2=CC=C(C=C2)N(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)CCC(=O)NCC2=CC=C(C=C2)N(C)C)C

InChI

InChI=1S/C21H29N3O3/c1-6-27-21(26)20-14(2)18(23-15(20)3)11-12-19(25)22-13-16-7-9-17(10-8-16)24(4)5/h7-10,23H,6,11-13H2,1-5H3,(H,22,25)