tert-butyl N-[2-[12-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]dodecanoylamino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[12-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]dodecanoylamino]ethyl]carbamate Openeye Name: tert-butyl N-[2-[12-[(6-chloro-2-methoxy-acridin-9-yl)amino]dodecanoylamino]ethyl]carbamate CAS Name: N-[2-[[12-[(6-chloro-2-methoxy-9-acridinyl)amino]-1-oxododecyl]amino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[12-[(6-chloro-2-methoxyacridin-9-yl)amino]dodecanoylamino]ethyl]carbamate Traditional Name: N-[2-[12-[(6-chloro-2-methoxy-acridin-9-yl)amino]dodecanoylamino]ethyl]carbamic acid tert-butyl ester Formula: C33H47ClN4O4 MolecularWeight: 599.20368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNC(=O)CCCCCCCCCCCNC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCNC(=O)CCCCCCCCCCCNC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC

InChI

InChI=1S/C33H47ClN4O4/c1-33(2,3)42-32(40)37-21-20-35-30(39)14-12-10-8-6-5-7-9-11-13-19-36-31-26-17-15-24(34)22-29(26)38-28-18-16-25(41-4)23-27(28)31/h15-18,22-23H,5-14,19-21H2,1-4H3,(H,35,39)(H,36,38)(H,37,40)