methyl 2-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methylamino]-3-phenyl-propanoate CAS Name: 2-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methylamino]-3-phenylpropanoate Traditional Name: 2-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methylamino]-3-phenyl-propionic acid methyl ester Formula: C27H28FN3O2 MolecularWeight: 445.528523

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CN=C(C2=CC=CC=C21)C3=CC=CC=C3F)CNC(CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CN1C(CN=C(C2=CC=CC=C21)C3=CC=CC=C3F)CNC(CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C27H28FN3O2/c1-31-20(17-29-24(27(32)33-2)16-19-10-4-3-5-11-19)18-30-26(21-12-6-8-14-23(21)28)22-13-7-9-15-25(22)31/h3-15,20,24,29H,16-18H2,1-2H3