ethyl 2-[5-[2-(phenoxycarbonylamino)ethanoyl]-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-4-yl]ethanoate

Systemtic Name: ethyl 2-[5-[2-(phenoxycarbonylamino)ethanoyl]-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-4-yl]ethanoate Openeye Name: ethyl 2-[5-[2-(phenoxycarbonylamino)acetyl]-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-4-yl]acetate CAS Name: 2-[5-[1-oxo-2-[[oxo(phenoxy)methyl]amino]ethyl]-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-4-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[2-(phenoxycarbonylamino)acetyl]-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-4-yl]acetate Traditional Name: 2-[5-[2-(carbophenoxyamino)acetyl]-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-4-yl]acetic acid ethyl ester Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C2=CC=CN2C3=CC=CC=C3CN1C(=O)CNC(=O)OC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC1C2=CC=CN2C3=CC=CC=C3CN1C(=O)CNC(=O)OC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O5/c1-2-32-24(30)15-22-21-13-8-14-27(21)20-12-7-6-9-18(20)17-28(22)23(29)16-26-25(31)33-19-10-4-3-5-11-19/h3-14,22H,2,15-17H2,1H3,(H,26,31)