[(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] naphthalene-1-carboxylate

Systemtic Name: [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] naphthalene-1-carboxylate Openeye Name: [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] ester IUPAC Name: [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [(E)-(3,6,6-trimethyl-1-phenyl-5,7-dihydroindazol-4-ylidene)amino] ester Formula: C27H25N3O2 MolecularWeight: 423.5063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NOC(=O)C3=CC=CC4=CC=CC=C43)CC(C2)(C)C)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1/C(=N/OC(=O)C3=CC=CC4=CC=CC=C43)/CC(C2)(C)C)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O2/c1-18-25-23(29-32-26(31)22-15-9-11-19-10-7-8-14-21(19)22)16-27(2,3)17-24(25)30(28-18)20-12-5-4-6-13-20/h4-15H,16-17H2,1-3H3/b29-23+