methyl 2-[[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-yl]carbonyl-phenyl-amino]methyl]-4,5-dihydroimidazole-1-carboxylate

Systemtic Name: methyl 2-[[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-yl]carbonyl-phenyl-amino]methyl]-4,5-dihydroimidazole-1-carboxylate Openeye Name: methyl 2-[(N-[7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carbonyl]anilino)methyl]-4,5-dihydroimidazole-1-carboxylate CAS Name: 2-[(N-[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-yl]-oxomethyl]anilino)methyl]-4,5-dihydroimidazole-1-carboxylic acid methyl ester IUPAC Name: methyl 2-[(N-[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carbonyl]anilino)methyl]-4,5-dihydroimidazole-1-carboxylate Traditional Name: 2-[(N-[7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carbonyl]anilino)methyl]-2-imidazoline-1-carboxylic acid methyl ester Formula: C30H29N3O4 MolecularWeight: 495.56896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)N(CC4=NCCN4C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)N(CC4=NCCN4C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C30H29N3O4/c1-21-8-10-22(11-9-21)23-12-13-27-25(18-23)19-24(14-17-37-27)29(34)33(26-6-4-3-5-7-26)20-28-31-15-16-32(28)30(35)36-2/h3-13,18-19H,14-17,20H2,1-2H3