methyl 5-[2-[(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-methyl-amino]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-[(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-methyl-amino]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-[(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-methyl-amino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-methylamino]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-methylamino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-methyl-amino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)CC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

Isomeric SMILES

CCN1CC(OC2=CC=CC=C21)CN(C)CC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

InChI

InChI=1S/C22H29N3O4/c1-6-25-12-16(29-19-10-8-7-9-17(19)25)11-24(4)13-18(26)21-14(2)20(15(3)23-21)22(27)28-5/h7-10,16,23H,6,11-13H2,1-5H3