methyl 2-[[5-methyl-4-oxidanylidene-6-[(phenylmethyl)amino]-3,1-benzoxazin-2-yl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[5-methyl-4-oxidanylidene-6-[(phenylmethyl)amino]-3,1-benzoxazin-2-yl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[6-(benzylamino)-5-methyl-4-oxo-3,1-benzoxazin-2-yl]amino]-3-phenyl-propanoate CAS Name: 2-[[5-methyl-4-oxo-6-[(phenylmethyl)amino]-3,1-benzoxazin-2-yl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[6-(benzylamino)-5-methyl-4-oxo-3,1-benzoxazin-2-yl]amino]-3-phenylpropanoate Traditional Name: 2-[[6-(benzylamino)-4-keto-5-methyl-3,1-benzoxazin-2-yl]amino]-3-phenyl-propionic acid methyl ester Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)NC(CC3=CC=CC=C3)C(=O)OC)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)NC(CC3=CC=CC=C3)C(=O)OC)NCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O4/c1-17-20(27-16-19-11-7-4-8-12-19)13-14-21-23(17)25(31)33-26(28-21)29-22(24(30)32-2)15-18-9-5-3-6-10-18/h3-14,22,27H,15-16H2,1-2H3,(H,28,29)