methyl 3-[(1-oxidanylidene-2-phenyl-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-[(1-oxidanylidene-2-phenyl-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)carbonylamino]propanoate Openeye Name: methyl 3-[(1-oxo-2-phenyl-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carbonyl)amino]propanoate CAS Name: 3-[[oxo-(1-oxo-2-phenyl-4-spiro[4H-isoquinoline-3,1'-cyclohexane]yl)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(1-oxo-2-phenylspiro[4H-isoquinoline-3,1'-cyclohexane]-4-carbonyl)amino]propanoate Traditional Name: 3-[(1-keto-2-phenyl-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carbonyl)amino]propionic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1C2=CC=CC=C2C(=O)N(C13CCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCNC(=O)C1C2=CC=CC=C2C(=O)N(C13CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N2O4/c1-31-21(28)14-17-26-23(29)22-19-12-6-7-13-20(19)24(30)27(18-10-4-2-5-11-18)25(22)15-8-3-9-16-25/h2,4-7,10-13,22H,3,8-9,14-17H2,1H3,(H,26,29)