2-diethylaminoethyl 1-(2,4-dimethylphenyl)isoquinoline-4-carboxylate

Systemtic Name: 2-diethylaminoethyl 1-(2,4-dimethylphenyl)isoquinoline-4-carboxylate Openeye Name: 2-diethylaminoethyl 1-(2,4-dimethylphenyl)isoquinoline-4-carboxylate CAS Name: 1-(2,4-dimethylphenyl)-4-isoquinolinecarboxylic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 1-(2,4-dimethylphenyl)isoquinoline-4-carboxylate Traditional Name: 1-(2,4-dimethylphenyl)isoquinoline-4-carboxylic acid 2-diethylaminoethyl ester Formula: C24H28N2O2 MolecularWeight: 376.49132

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CN=C(C2=CC=CC=C21)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CN=C(C2=CC=CC=C21)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C24H28N2O2/c1-5-26(6-2)13-14-28-24(27)22-16-25-23(21-10-8-7-9-20(21)22)19-12-11-17(3)15-18(19)4/h7-12,15-16H,5-6,13-14H2,1-4H3