methyl 3-[4-[2-oxidanylidene-3-[3-(phenylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]imidazolidin-1-yl]cyclohexyl]propanoate hydrochloride

Systemtic Name: methyl 3-[4-[2-oxidanylidene-3-[3-(phenylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]imidazolidin-1-yl]cyclohexyl]propanoate hydrochloride Openeye Name: methyl 3-[4-[3-(3-benzyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-oxo-imidazolidin-1-yl]cyclohexyl]propanoate hydrochloride CAS Name: 3-[4-[2-oxo-3-[3-(phenylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-1-imidazolidinyl]cyclohexyl]propanoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[4-[3-(3-benzyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-oxoimidazolidin-1-yl]cyclohexyl]propanoate hydrochloride Traditional Name: 3-[4-[3-(3-benzyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-keto-imidazolidin-1-yl]cyclohexyl]propionic acid methyl ester hydrochloride Formula: C30H40ClN3O3 MolecularWeight: 526.1099

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1CCC(CC1)N2CCN(C2=O)C3=CC4=C(CCN(CC4)CC5=CC=CC=C5)C=C3.Cl

Isomeric SMILES

COC(=O)CCC1CCC(CC1)N2CCN(C2=O)C3=CC4=C(CCN(CC4)CC5=CC=CC=C5)C=C3.Cl

InChI

InChI=1S/C30H39N3O3.ClH/c1-36-29(34)14-9-23-7-11-27(12-8-23)32-19-20-33(30(32)35)28-13-10-25-15-17-31(18-16-26(25)21-28)22-24-5-3-2-4-6-24;/h2-6,10,13,21,23,27H,7-9,11-12,14-20,22H2,1H3;1H