ethyl 4-[8-methoxy-6-[(nonanoylamino)methyl]-2,4-dihydro-1,3-benzoxazin-3-yl]benzoate

Systemtic Name: ethyl 4-[8-methoxy-6-[(nonanoylamino)methyl]-2,4-dihydro-1,3-benzoxazin-3-yl]benzoate Openeye Name: ethyl 4-[8-methoxy-6-[(nonanoylamino)methyl]-2,4-dihydro-1,3-benzoxazin-3-yl]benzoate CAS Name: 4-[8-methoxy-6-[(1-oxononylamino)methyl]-2,4-dihydro-1,3-benzoxazin-3-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[8-methoxy-6-[(nonanoylamino)methyl]-2,4-dihydro-1,3-benzoxazin-3-yl]benzoate Traditional Name: 4-[8-methoxy-6-[(pelargonylamino)methyl]-2,4-dihydro-1,3-benzoxazin-3-yl]benzoic acid ethyl ester Formula: C28H38N2O5 MolecularWeight: 482.61172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NCC1=CC(=C2C(=C1)CN(CO2)C3=CC=C(C=C3)C(=O)OCC)OC

Isomeric SMILES

CCCCCCCCC(=O)NCC1=CC(=C2C(=C1)CN(CO2)C3=CC=C(C=C3)C(=O)OCC)OC

InChI

InChI=1S/C28H38N2O5/c1-4-6-7-8-9-10-11-26(31)29-18-21-16-23-19-30(20-35-27(23)25(17-21)33-3)24-14-12-22(13-15-24)28(32)34-5-2/h12-17H,4-11,18-20H2,1-3H3,(H,29,31)