8-[2-azanyl-4-(4-cyanophenoxy)butyl]-N-prop-2-enyl-3,8-diazabicyclo[3.2.1]octane-3-carboxamide

Systemtic Name: 8-[2-azanyl-4-(4-cyanophenoxy)butyl]-N-prop-2-enyl-3,8-diazabicyclo[3.2.1]octane-3-carboxamide Openeye Name: N-allyl-8-[2-amino-4-(4-cyanophenoxy)butyl]-3,8-diazabicyclo[3.2.1]octane-3-carboxamide CAS Name: 8-[2-amino-4-(4-cyanophenoxy)butyl]-N-prop-2-enyl-3,8-diazabicyclo[3.2.1]octane-3-carboxamide IUPAC Name: 8-[2-amino-4-(4-cyanophenoxy)butyl]-N-prop-2-enyl-3,8-diazabicyclo[3.2.1]octane-3-carboxamide Traditional Name: N-allyl-8-[2-amino-4-(4-cyanophenoxy)butyl]-3,8-diazabicyclo[3.2.1]octane-3-carboxamide Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)N1CC2CCC(C1)N2CC(CCOC3=CC=C(C=C3)C#N)N

Isomeric SMILES

C=CCNC(=O)N1CC2CCC(C1)N2CC(CCOC3=CC=C(C=C3)C#N)N

InChI

InChI=1S/C21H29N5O2/c1-2-10-24-21(27)25-14-18-5-6-19(15-25)26(18)13-17(23)9-11-28-20-7-3-16(12-22)4-8-20/h2-4,7-8,17-19H,1,5-6,9-11,13-15,23H2,(H,24,27)