ethyl 3-[4-[3-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate

Systemtic Name: ethyl 3-[4-[3-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate Openeye Name: ethyl 3-[4-[3-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-oxo-imidazolidin-1-yl]phenyl]propanoate CAS Name: 3-[4-[3-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-oxo-1-imidazolidinyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[3-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-oxoimidazolidin-1-yl]phenyl]propanoate Traditional Name: 3-[4-[2-keto-3-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)imidazolidin-1-yl]phenyl]propionic acid ethyl ester Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3=CC4=C(CCN(CC4)C)C=C3

Isomeric SMILES

CCOC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3=CC4=C(CCN(CC4)C)C=C3

InChI

InChI=1S/C25H31N3O3/c1-3-31-24(29)11-6-19-4-8-22(9-5-19)27-16-17-28(25(27)30)23-10-7-20-12-14-26(2)15-13-21(20)18-23/h4-5,7-10,18H,3,6,11-17H2,1-2H3