tert-butyl N-[4-[anthracen-9-ylmethyl(3-cyanopropyl)amino]butyl]carbamate

Systemtic Name: tert-butyl N-[4-[anthracen-9-ylmethyl(3-cyanopropyl)amino]butyl]carbamate Openeye Name: tert-butyl N-[4-[9-anthrylmethyl(3-cyanopropyl)amino]butyl]carbamate CAS Name: N-[4-[9-anthracenylmethyl(3-cyanopropyl)amino]butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[anthracen-9-ylmethyl(3-cyanopropyl)amino]butyl]carbamate Traditional Name: N-[4-[9-anthrylmethyl(3-cyanopropyl)amino]butyl]carbamic acid tert-butyl ester Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCN(CCCC#N)CC1=C2C=CC=CC2=CC3=CC=CC=C31

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCN(CCCC#N)CC1=C2C=CC=CC2=CC3=CC=CC=C31

InChI

InChI=1S/C28H35N3O2/c1-28(2,3)33-27(32)30-17-9-11-19-31(18-10-8-16-29)21-26-24-14-6-4-12-22(24)20-23-13-5-7-15-25(23)26/h4-7,12-15,20H,8-11,17-19,21H2,1-3H3,(H,30,32)