methyl (2S)-2-[[1-(7-methoxy-4-methyl-quinazolin-2-yl)piperidin-3-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[1-(7-methoxy-4-methyl-quinazolin-2-yl)piperidin-3-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[1-(7-methoxy-4-methyl-quinazolin-2-yl)piperidine-3-carbonyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[[1-(7-methoxy-4-methyl-2-quinazolinyl)-3-piperidinyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[1-(7-methoxy-4-methylquinazolin-2-yl)piperidine-3-carbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[1-(7-methoxy-4-methyl-quinazolin-2-yl)nipecotoyl]amino]-2-phenyl-acetic acid methyl ester Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)OC)N3CCCC(C3)C(=O)NC(C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)OC)N3CCCC(C3)C(=O)N[C@@H](C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H28N4O4/c1-16-20-12-11-19(32-2)14-21(20)27-25(26-16)29-13-7-10-18(15-29)23(30)28-22(24(31)33-3)17-8-5-4-6-9-17/h4-6,8-9,11-12,14,18,22H,7,10,13,15H2,1-3H3,(H,28,30)/t18?,22-/m0/s1