3-butyl-N-[(E)-1-[3-(diethylaminomethyl)-4-methoxy-phenyl]ethylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[(E)-1-[3-(diethylaminomethyl)-4-methoxy-phenyl]ethylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[(E)-1-[3-(diethylaminomethyl)-4-methoxy-phenyl]ethylideneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[(E)-1-[3-(diethylaminomethyl)-4-methoxyphenyl]ethylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[(E)-1-[3-(diethylaminomethyl)-4-methoxyphenyl]ethylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-[(E)-1-[3-(diethylaminomethyl)-4-methoxy-phenyl]ethylideneamino]-4-keto-phthalazine-1-carboxamide Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=CC(=C(C=C3)OC)CN(CC)CC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(\C)/C3=CC(=C(C=C3)OC)CN(CC)CC

InChI

InChI=1S/C27H35N5O3/c1-6-9-16-32-27(34)23-13-11-10-12-22(23)25(30-32)26(33)29-28-19(4)20-14-15-24(35-5)21(17-20)18-31(7-2)8-3/h10-15,17H,6-9,16,18H2,1-5H3,(H,29,33)/b28-19+