2-[4-[4-(aminomethyl)piperidin-1-yl]-6-oxidanylidene-pyridazin-1-yl]ethyl benzoate

Systemtic Name: 2-[4-[4-(aminomethyl)piperidin-1-yl]-6-oxidanylidene-pyridazin-1-yl]ethyl benzoate Openeye Name: 2-[4-[4-(aminomethyl)-1-piperidyl]-6-oxo-pyridazin-1-yl]ethyl benzoate CAS Name: benzoic acid 2-[4-[4-(aminomethyl)-1-piperidinyl]-6-oxo-1-pyridazinyl]ethyl ester IUPAC Name: 2-[4-[4-(aminomethyl)piperidin-1-yl]-6-oxopyridazin-1-yl]ethyl benzoate Traditional Name: benzoic acid 2-[4-[4-(aminomethyl)piperidino]-6-keto-pyridazin-1-yl]ethyl ester Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)C2=CC(=O)N(N=C2)CCOC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CN)C2=CC(=O)N(N=C2)CCOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H24N4O3/c20-13-15-6-8-22(9-7-15)17-12-18(24)23(21-14-17)10-11-26-19(25)16-4-2-1-3-5-16/h1-5,12,14-15H,6-11,13,20H2