5-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 5-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 5-[3-(4-allyl-2-methoxy-phenoxy)propyl]-1-benzoyl-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-5-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-5-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 5-[3-(4-allyl-2-methoxy-phenoxy)propyl]-1-benzoyl-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C30H32N2O4 MolecularWeight: 484.58608

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CCCOC3=C(C=C(C=C3)CC=C)OC)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCCOC3=C(C=C(C=C3)CC=C)OC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H32N2O4/c1-4-11-23-16-17-27(28(20-23)35-3)36-19-10-18-31-25-14-8-9-15-26(25)32(21-22(2)29(31)33)30(34)24-12-6-5-7-13-24/h4-9,12-17,20,22H,1,10-11,18-19,21H2,2-3H3