3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]-5-(4-phenylpiperidin-1-yl)carbonyl-2H-1,2,3-triazol-4-one

Systemtic Name: 3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]-5-(4-phenylpiperidin-1-yl)carbonyl-2H-1,2,3-triazol-4-one Openeye Name: 3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-5-(4-phenylpiperidine-1-carbonyl)-2H-triazol-4-one CAS Name: 3-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-5-[oxo-(4-phenyl-1-piperidinyl)methyl]-2H-triazol-4-one IUPAC Name: 3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-5-(4-phenylpiperidine-1-carbonyl)-2H-triazol-4-one Traditional Name: 3-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]-5-(4-phenylpiperidine-1-carbonyl)-2H-triazol-4-one Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2)C(=O)C3=NNN(C3=O)NC=C4C=CC(=O)C=C4

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2)C(=O)C3=NNN(C3=O)NC=C4C=CC(=O)C=C4

InChI

InChI=1S/C21H21N5O3/c27-18-8-6-15(7-9-18)14-22-26-21(29)19(23-24-26)20(28)25-12-10-17(11-13-25)16-4-2-1-3-5-16/h1-9,14,17,22,24H,10-13H2