4-phenylbutyl 2-(phenylcarbamoyl)-1,2-diazinane-1-carboxylate

Systemtic Name: 4-phenylbutyl 2-(phenylcarbamoyl)-1,2-diazinane-1-carboxylate Openeye Name: 4-phenylbutyl 2-(phenylcarbamoyl)hexahydropyridazine-1-carboxylate CAS Name: 2-[anilino(oxo)methyl]-1-diazinanecarboxylic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 2-(phenylcarbamoyl)diazinane-1-carboxylate Traditional Name: 2-(phenylcarbamoyl)hexahydropyridazine-1-carboxylic acid 4-phenylbutyl ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(N(C1)C(=O)NC2=CC=CC=C2)C(=O)OCCCCC3=CC=CC=C3

Isomeric SMILES

C1CCN(N(C1)C(=O)NC2=CC=CC=C2)C(=O)OCCCCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c26-21(23-20-14-5-2-6-15-20)24-16-8-9-17-25(24)22(27)28-18-10-7-13-19-11-3-1-4-12-19/h1-6,11-12,14-15H,7-10,13,16-18H2,(H,23,26)