ethyl 6-oxidanyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl 6-oxidanyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 6-hydroxy-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 6-hydroxy-1-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-hydroxy-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-hydroxy-1-[4-(2-pyrrolidinoethoxy)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C24H30N2O4 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C1C3=CC=C(C=C3)OCCN4CCCC4)C=CC(=C2)O

Isomeric SMILES

CCOC(=O)N1CCC2=C(C1C3=CC=C(C=C3)OCCN4CCCC4)C=CC(=C2)O

InChI

InChI=1S/C24H30N2O4/c1-2-29-24(28)26-14-11-19-17-20(27)7-10-22(19)23(26)18-5-8-21(9-6-18)30-16-15-25-12-3-4-13-25/h5-10,17,23,27H,2-4,11-16H2,1H3