2-methoxyethyl 3-azanyl-4-[[3-(4-ethyl-1,4-diazepan-1-yl)phenyl]amino]benzoate

Systemtic Name: 2-methoxyethyl 3-azanyl-4-[[3-(4-ethyl-1,4-diazepan-1-yl)phenyl]amino]benzoate Openeye Name: 2-methoxyethyl 3-amino-4-[3-(4-ethyl-1,4-diazepan-1-yl)anilino]benzoate CAS Name: 3-amino-4-[3-(4-ethyl-1,4-diazepan-1-yl)anilino]benzoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-amino-4-[3-(4-ethyl-1,4-diazepan-1-yl)anilino]benzoate Traditional Name: 3-amino-4-[3-(4-ethyl-1,4-diazepan-1-yl)anilino]benzoic acid 2-methoxyethyl ester Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCOC)N

Isomeric SMILES

CCN1CCCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCOC)N

InChI

InChI=1S/C23H32N4O3/c1-3-26-10-5-11-27(13-12-26)20-7-4-6-19(17-20)25-22-9-8-18(16-21(22)24)23(28)30-15-14-29-2/h4,6-9,16-17,25H,3,5,10-15,24H2,1-2H3