2-[4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]piperazin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-[4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]piperazin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-[4-(tert-butoxycarbonylamino)butanoyl]piperazin-1-yl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]piperazin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-[4-(tert-butoxycarbonylamino)butanoyl]piperazino]ethyl ester Formula: C23H35ClN4O6 MolecularWeight: 499.0002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(=O)N1CCN(CC1)CCOC(=O)C2=CC(=C(C=C2OC)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(=O)N1CCN(CC1)CCOC(=O)C2=CC(=C(C=C2OC)N)Cl

InChI

InChI=1S/C23H35ClN4O6/c1-23(2,3)34-22(31)26-7-5-6-20(29)28-10-8-27(9-11-28)12-13-33-21(30)16-14-17(24)18(25)15-19(16)32-4/h14-15H,5-13,25H2,1-4H3,(H,26,31)