(phenylmethyl) (NE)-N-[(cyclohexa-1,5-dien-1-ylamino)-(phenylmethoxycarbonylamino)methylidene]carbamate

Systemtic Name: (phenylmethyl) (NE)-N-[(cyclohexa-1,5-dien-1-ylamino)-(phenylmethoxycarbonylamino)methylidene]carbamate Openeye Name: benzyl (NE)-N-[benzyloxycarbonylamino-(cyclohexa-1,5-dien-1-ylamino)methylene]carbamate CAS Name: (NE)-N-[(1-cyclohexa-1,5-dienylamino)-(phenylmethoxycarbonylamino)methylidene]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl (NE)-N-[(cyclohexa-1,5-dien-1-ylamino)-(phenylmethoxycarbonylamino)methylidene]carbamate Traditional Name: (NE)-N-[benzyloxycarbonylamino-(cyclohexa-1,5-dien-1-ylamino)methylene]carbamic acid benzyl ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C=C1)NC(=NC(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC=C(C=C1)N/C(=N\C(=O)OCC2=CC=CC=C2)/NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H23N3O4/c27-22(29-16-18-10-4-1-5-11-18)25-21(24-20-14-8-3-9-15-20)26-23(28)30-17-19-12-6-2-7-13-19/h1-2,4-8,10-15H,3,9,16-17H2,(H2,24,25,26,27,28)