methyl 3-[4-[2,2-diethoxyethyl-[(3-ethyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)carbamoyl]amino]cyclohexyl]propanoate

Systemtic Name: methyl 3-[4-[2,2-diethoxyethyl-[(3-ethyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)carbamoyl]amino]cyclohexyl]propanoate Openeye Name: methyl 3-[4-[2,2-diethoxyethyl-[(3-ethyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)carbamoyl]amino]cyclohexyl]propanoate CAS Name: 3-[4-[2,2-diethoxyethyl-[[(3-ethyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)amino]-oxomethyl]amino]cyclohexyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[2,2-diethoxyethyl-[(3-ethyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)carbamoyl]amino]cyclohexyl]propanoate Traditional Name: 3-[4-[2,2-diethoxyethyl-[(3-ethyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)carbamoyl]amino]cyclohexyl]propionic acid methyl ester Formula: C29H47N3O5 MolecularWeight: 517.70058

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(CC1)C=C(C=C2)NC(=O)N(CC(OCC)OCC)C3CCC(CC3)CCC(=O)OC

Isomeric SMILES

CCN1CCC2=C(CC1)C=C(C=C2)NC(=O)N(CC(OCC)OCC)C3CCC(CC3)CCC(=O)OC

InChI

InChI=1S/C29H47N3O5/c1-5-31-18-16-23-11-12-25(20-24(23)17-19-31)30-29(34)32(21-28(36-6-2)37-7-3)26-13-8-22(9-14-26)10-15-27(33)35-4/h11-12,20,22,26,28H,5-10,13-19,21H2,1-4H3,(H,30,34)