propyl (1Z)-3-(diethylamino)-1-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-2H-isoquinoline-4-carboxylate

Systemtic Name: propyl (1Z)-3-(diethylamino)-1-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-2H-isoquinoline-4-carboxylate Openeye Name: propyl (1Z)-3-(diethylamino)-1-(6-oxocyclohexa-2,4-dien-1-ylidene)-2H-isoquinoline-4-carboxylate CAS Name: (1Z)-3-(diethylamino)-1-(6-oxo-1-cyclohexa-2,4-dienylidene)-2H-isoquinoline-4-carboxylic acid propyl ester IUPAC Name: propyl (1Z)-3-(diethylamino)-1-(6-oxocyclohexa-2,4-dien-1-ylidene)-2H-isoquinoline-4-carboxylate Traditional Name: (1Z)-3-(diethylamino)-1-(6-ketocyclohexa-2,4-dien-1-ylidene)-2H-isoquinoline-4-carboxylic acid propyl ester Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(NC(=C2C=CC=CC2=O)C3=CC=CC=C31)N(CC)CC

Isomeric SMILES

CCCOC(=O)C1=C(N/C(=C\2/C=CC=CC2=O)/C3=CC=CC=C31)N(CC)CC

InChI

InChI=1S/C23H26N2O3/c1-4-15-28-23(27)20-16-11-7-8-12-17(16)21(18-13-9-10-14-19(18)26)24-22(20)25(5-2)6-3/h7-14,24H,4-6,15H2,1-3H3/b21-18-