(2S)-4-[2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-[2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-[2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]acetyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[2-[(2-methoxy-5-methylphenyl)methyl-methylamino]-1-oxoethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-[2-[(2-methoxy-5-methylphenyl)methyl-methylamino]acetyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-[2-[(2-methoxy-5-methyl-benzyl)-methyl-amino]acetyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN(C)CC(=O)N2CC(OC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN(C)CC(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C22H27N3O4/c1-15-9-10-18(28-4)16(11-15)12-24(3)14-21(26)25-13-20(22(27)23-2)29-19-8-6-5-7-17(19)25/h5-11,20H,12-14H2,1-4H3,(H,23,27)/t20-/m0/s1