phenyl N-[2,4-bis(oxidanylidene)-1-(3-oxidanylpropyl)-5-phenyl-1,5-benzodiazepin-3-yl]carbamate

Systemtic Name: phenyl N-[2,4-bis(oxidanylidene)-1-(3-oxidanylpropyl)-5-phenyl-1,5-benzodiazepin-3-yl]carbamate Openeye Name: phenyl N-[1-(3-hydroxypropyl)-2,4-dioxo-5-phenyl-1,5-benzodiazepin-3-yl]carbamate CAS Name: N-[1-(3-hydroxypropyl)-2,4-dioxo-5-phenyl-1,5-benzodiazepin-3-yl]carbamic acid phenyl ester IUPAC Name: phenyl N-[1-(3-hydroxypropyl)-2,4-dioxo-5-phenyl-1,5-benzodiazepin-3-yl]carbamate Traditional Name: N-[1-(3-hydroxypropyl)-2,4-diketo-5-phenyl-1,5-benzodiazepin-3-yl]carbamic acid phenyl ester Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC=C3N(C(=O)C(C2=O)NC(=O)OC4=CC=CC=C4)CCCO

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC=C3N(C(=O)C(C2=O)NC(=O)OC4=CC=CC=C4)CCCO

InChI

InChI=1S/C25H23N3O5/c29-17-9-16-27-20-14-7-8-15-21(20)28(18-10-3-1-4-11-18)24(31)22(23(27)30)26-25(32)33-19-12-5-2-6-13-19/h1-8,10-15,22,29H,9,16-17H2,(H,26,32)