[5-[3-(1,4-diazepan-1-yl)propoxycarbonylamino]-2,3-dimethoxy-phenyl] ethanoate

Systemtic Name: [5-[3-(1,4-diazepan-1-yl)propoxycarbonylamino]-2,3-dimethoxy-phenyl] ethanoate Openeye Name: [5-[3-(1,4-diazepan-1-yl)propoxycarbonylamino]-2,3-dimethoxy-phenyl] acetate CAS Name: acetic acid [5-[[3-(1,4-diazepan-1-yl)propoxy-oxomethyl]amino]-2,3-dimethoxyphenyl] ester IUPAC Name: [5-[3-(1,4-diazepan-1-yl)propoxycarbonylamino]-2,3-dimethoxyphenyl] acetate Traditional Name: acetic acid [5-[3-(1,4-diazepan-1-yl)propoxycarbonylamino]-2,3-dimethoxy-phenyl] ester Formula: C19H29N3O6 MolecularWeight: 395.45006

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=CC(=C1)NC(=O)OCCCN2CCCNCC2)OC)OC

Isomeric SMILES

CC(=O)OC1=C(C(=CC(=C1)NC(=O)OCCCN2CCCNCC2)OC)OC

InChI

InChI=1S/C19H29N3O6/c1-14(23)28-17-13-15(12-16(25-2)18(17)26-3)21-19(24)27-11-5-9-22-8-4-6-20-7-10-22/h12-13,20H,4-11H2,1-3H3,(H,21,24)