tert-butyl N-(anthracen-9-ylmethyl)-N-[5-(4-azanylbutylamino)pentyl]carbamate

Systemtic Name: tert-butyl N-(anthracen-9-ylmethyl)-N-[5-(4-azanylbutylamino)pentyl]carbamate Openeye Name: tert-butyl N-[5-(4-aminobutylamino)pentyl]-N-(9-anthrylmethyl)carbamate CAS Name: N-[5-(4-aminobutylamino)pentyl]-N-(9-anthracenylmethyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-(4-aminobutylamino)pentyl]-N-(anthracen-9-ylmethyl)carbamate Traditional Name: N-[5-(4-aminobutylamino)pentyl]-N-(9-anthrylmethyl)carbamic acid tert-butyl ester Formula: C29H41N3O2 MolecularWeight: 463.65474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCCCNCCCCN)CC1=C2C=CC=CC2=CC3=CC=CC=C31

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCCCNCCCCN)CC1=C2C=CC=CC2=CC3=CC=CC=C31

InChI

InChI=1S/C29H41N3O2/c1-29(2,3)34-28(33)32(20-12-4-10-18-31-19-11-9-17-30)22-27-25-15-7-5-13-23(25)21-24-14-6-8-16-26(24)27/h5-8,13-16,21,31H,4,9-12,17-20,22,30H2,1-3H3