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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4/c1-6-25-13-16(29-18-11-9-8-10-17(18)25)12-24(5)21(26)20-14(3)19(15(4)23-20)22(27)28-7-2/h8-11,16,23H,6-7,12-13H2,1-5H3